methyl 7-[(E)-2-(6-cyanonaphthalen-2-yl)ethenyl]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: methyl 7-[(E)-2-(6-cyanonaphthalen-2-yl)ethenyl]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: methyl 7-[(E)-2-(6-cyano-2-naphthyl)vinyl]-1-isopropyl-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 7-[(E)-2-(6-cyano-2-naphthalenyl)ethenyl]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester IUPAC Name: methyl 7-[(E)-2-(6-cyanonaphthalen-2-yl)ethenyl]-1-propan-2-yl-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 7-[(E)-2-(6-cyano-2-naphthyl)vinyl]-1-isopropyl-3,4-dihydro-1H-isoquinoline-2-carboxylic acid methyl ester Formula: C27H26N2O2 MolecularWeight: 410.50754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1C2=C(CCN1C(=O)OC)C=CC(=C2)C=CC3=CC4=C(C=C3)C=C(C=C4)C#N

Isomeric SMILES

CC(C)C1C2=C(CCN1C(=O)OC)C=CC(=C2)/C=C/C3=CC4=C(C=C3)C=C(C=C4)C#N

InChI

InChI=1S/C27H26N2O2/c1-18(2)26-25-16-20(6-9-22(25)12-13-29(26)27(30)31-3)5-4-19-7-10-24-15-21(17-28)8-11-23(24)14-19/h4-11,14-16,18,26H,12-13H2,1-3H3/b5-4+